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Fig. 6 | Journal of Cheminformatics

Fig. 6

From: Predictiveness curves in virtual screening

Fig. 6

Predictiveness and ROC curves for the virtual screenings of the 39 targets we selected from the DUD datasets using Surflex-dock, ICM and Autodock Vina (black, red and green curves, respectively). Dashed gray lines indicate the prevalence of activity and random picking of compounds. Vertical dashed lines represent the thresholds we manually selected from the analysis of the curves. Metrics associated to the selected thresholds are available in Tables 2, 3, 4. Partial metrics at 2 and 5 % of the ranked dataset are available in Additional file 1: Table S1; Additional file 2: Table S2 and Additional file 3: Table S3

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